6-(2-chloroanilino)-1H-1,3,5-triazine-2,4-dione
TL;DR: 6-(2-chloroanilino)-1H-1,3,5-triazine-2,4-dione (CAS 111844-27-0) is a chemical compound with molecular formula C9H7ClN4O2 and molecular weight 238.02576 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
6-(2-chloroanilino)-1H-1,3,5-triazine-2,4-dione
Also Known As: 6-(2-chloroanilino)-1H-1,3,5-triazine-2,4-dione, 6-[(2-Chlorophenyl)amino]-1,3,5-triazine-2,4-diol, 6-(2-Chloroanilino)-1,3,5-triazine-2,4(1H,3H)-dione, 6-[(2-chlorophenyl)amino]-1H-1,3,5-triazine-2,4-dione
Technical Specifications
| Molecular Formula | C9H7ClN4O2 |
| Molecular Weight | 238.02576 g/mol |
| XLogP | 1.1 |
| Topological Polar Surface Area (TPSA) | 82.6 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 238.02576 Da |
| Heavy Atoms | 16 |
| Complexity | 344.0 |
| SMILES | C1=CC=C(C(=C1)NC2=NC(=O)NC(=O)N2)Cl |
| InChIKey | WYAUMXAKQAGSRN-UHFFFAOYSA-N |
Chemical Property Profile of 6-(2-chloroanilino)-1H-1,3,5-triazine-2,4-dione
Property Insights of 6-(2-chloroanilino)-1H-1,3,5-triazine-2,4-dione
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-(2-chloroanilino)-1H-1,3,5-triazine-2,4-dione. The TPSA of 82.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-(2-chloroanilino)-1H-1,3,5-triazine-2,4-dione. Following Lipinski's Rule of Five, 6-(2-chloroanilino)-1H-1,3,5-triazine-2,4-dione has 3 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 6-(2-chloroanilino)-1H-1,3,5-triazine-2,4-dione?
The CAS number of 6-(2-chloroanilino)-1H-1,3,5-triazine-2,4-dione is 111844-27-0.
What is the molecular formula of 6-(2-chloroanilino)-1H-1,3,5-triazine-2,4-dione?
The molecular formula of 6-(2-chloroanilino)-1H-1,3,5-triazine-2,4-dione is C9H7ClN4O2.
What is the molecular weight of 6-(2-chloroanilino)-1H-1,3,5-triazine-2,4-dione?
The molecular weight of 6-(2-chloroanilino)-1H-1,3,5-triazine-2,4-dione is 238.02576 g/mol.
Where can I buy 6-(2-chloroanilino)-1H-1,3,5-triazine-2,4-dione?
You can request a quote for 6-(2-chloroanilino)-1H-1,3,5-triazine-2,4-dione directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 6-(2-chloroanilino)-1H-1,3,5-triazine-2,4-dione?
Yes, CoreyChem provides custom synthesis services for 6-(2-chloroanilino)-1H-1,3,5-triazine-2,4-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.